1-ethyl-4-fluoro-4-propan-2-ylpiperidine

C10H20FN — CID 163258367

IUPAC1-ethyl-4-fluoro-4-propan-2-ylpiperidine
SMILESCCN1CCC(F)(C(C)C)CC1
InChIInChI=1S/C10H20FN/c1-4-12-7-5-10(11,6-8-12)9(2)3/h9H,4-8H2,1-3H3
InChIKeyNXRBWRJYUGMQLH-UHFFFAOYSA-N
MW173.27 g/mol
LogP2.47
Rot. Bonds2

About 1-ethyl-4-fluoro-4-propan-2-ylpiperidine

1-ethyl-4-fluoro-4-propan-2-ylpiperidine (PubChem CID 163258367) has the molecular formula C10H20FN and a molecular weight of 173.27 g/mol. Its IUPAC name is 1-ethyl-4-fluoro-4-propan-2-ylpiperidine.

Molecular Properties

Compound Name1-ethyl-4-fluoro-4-propan-2-ylpiperidine
PubChem CID163258367
Molecular FormulaC10H20FN
Molecular Weight173.27 g/mol
Exact Mass173.16
IUPAC Name1-ethyl-4-fluoro-4-propan-2-ylpiperidine
SMILESCCN1CCC(F)(C(C)C)CC1
InChIInChI=1S/C10H20FN/c1-4-12-7-5-10(11,6-8-12)9(2)3/h9H,4-8H2,1-3H3
InChIKeyNXRBWRJYUGMQLH-UHFFFAOYSA-N
XLogP2.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.27
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1-ethyl-4-fluoropiperidin-4-yl)-2,2,2-trifluoroethanol
CID 151699939
1-ethyl-5,5-difluoroazocane
CID 162614940
1-ethyl-4-fluoro-4-iodopiperidine
CID 147786451
3,9-diethyl-3,9-diazaspiro[5.5]undecane
CID 20622591
4-fluoro-1-methyl-4-propan-2-ylpiperidine;1-methyl-4-propan-2-ylpiperidine
CID 172607002
1-ethyl-4,4-dimethylpiperidine;hydrate
CID 178113144
1,3-diethyl-3-propan-2-ylpyrrolidine
CID 131976816
1-ethyl-4-[(1-fluorocyclopropyl)methyl]piperazine
CID 130668663
1,4,7,10,13,16-hexaethyl-1,4,7,10,13,16-hexazacyclooctadecane
CID 66730221
1-ethyl-4-fluoropiperidine-4-carboxylic acid;hydrochloride
CID 90079651
3-fluoro-3-propan-2-yl-1-propylazetidine
CID 163258527
1,4-diethyl-4-iodopiperidine
CID 118535824

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-fluoro-4-propan-2-ylpiperidine?
The IUPAC name of 1-ethyl-4-fluoro-4-propan-2-ylpiperidine (CID 163258367) is 1-ethyl-4-fluoro-4-propan-2-ylpiperidine.
What is the SMILES notation for 1-ethyl-4-fluoro-4-propan-2-ylpiperidine?
The canonical SMILES for 1-ethyl-4-fluoro-4-propan-2-ylpiperidine is CCN1CCC(F)(C(C)C)CC1.
What is the InChIKey of 1-ethyl-4-fluoro-4-propan-2-ylpiperidine?
The InChIKey is NXRBWRJYUGMQLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FN/c1-4-12-7-5-10(11,6-8-12)9(2)3/h9H,4-8H2,1-3H3.
What are the key properties of 1-ethyl-4-fluoro-4-propan-2-ylpiperidine?
1-ethyl-4-fluoro-4-propan-2-ylpiperidine has a molecular weight of 173.27 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-fluoro-4-propan-2-ylpiperidine is sourced from PubChem (CID 163258367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).